Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | CA7 | P43166 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.54 |
| ▸ | APP | P05067 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2094102 | 0.96 | CA12 (0.58) | CA12CA1CA2CA7CA9 | |
| SCHEMBL5014888 | 0.79 | CA12 (0.58) | CA12CA1CA2CA7CA9 | |
| Nitrogen SCHEMBL28234700 | 0.78 | APP (0.49) | APPALDH1A1MEN1KMT2AHTT | |
| SCHEMBL24317926 | 0.77 | CA1 (0.50) | CA12CA1CA2CA7CA9 | |
| SCHEMBL24316177 | 0.77 | CA12 (0.50) | CA12CA1CA2CA7CA9 | |
| SCHEMBL10622463 | 0.75 | ACHE (0.58) | APPALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL11135619 | 0.75 | CA12 (0.42) | CA12CA1CA2CA7CA9 | |
| SCHEMBL9513866 | 0.74 | CA12 (0.52) | CA12CA1CA2CA7CA9 | |
| SCHEMBL31257110 | 0.74 | CA12 (0.52) | CA12CA1CA2CA7CA9 | |
| SCHEMBL7969895 | 0.73 | CA12 (0.40) | CA12CA1CA2CA7CA9 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4296194-A | O-QUINONE DIAZIDE AND/OR DIAZONIUM COMPOUND, DECOMPOSITION, REACTION WITH AZO DYE TO PRODUCE DIFFERENT COLOR | VICKERS LIMITED (GB) | 1981-10-20 | — | — | US | claimed |